ethyl 3-[(2-ethoxy-2-oxidanylidene-ethanoyl)-[2-nitro-4-(trifluoromethyl)phenyl]amino]propanoate

Systemtic Name: ethyl 3-[(2-ethoxy-2-oxidanylidene-ethanoyl)-[2-nitro-4-(trifluoromethyl)phenyl]amino]propanoate Openeye Name: ethyl 3-[N-(2-ethoxy-2-oxo-acetyl)-2-nitro-4-(trifluoromethyl)anilino]propanoate CAS Name: 3-[N-(2-ethoxy-1,2-dioxoethyl)-2-nitro-4-(trifluoromethyl)anilino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[N-(2-ethoxy-2-oxoacetyl)-2-nitro-4-(trifluoromethyl)anilino]propanoate Traditional Name: 3-[N-ethoxalyl-2-nitro-4-(trifluoromethyl)anilino]propionic acid ethyl ester Formula: C16H17F3N2O7 MolecularWeight: 406.31059

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(C1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-])C(=O)C(=O)OCC

Isomeric SMILES

CCOC(=O)CCN(C1=C(C=C(C=C1)C(F)(F)F)[N+](=O)[O-])C(=O)C(=O)OCC

InChI

InChI=1S/C16H17F3N2O7/c1-3-27-13(22)7-8-20(14(23)15(24)28-4-2)11-6-5-10(16(17,18)19)9-12(11)21(25)26/h5-6,9H,3-4,7-8H2,1-2H3